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Information card for entry 4346968
Preview
Coordinates | 4346968.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H48 Cl2 Fe N6 Pd |
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Calculated formula | C32 H48 Cl2 Fe N6 Pd |
SMILES | [c]123[cH]4[cH]5[cH]6[cH]1[Fe]17892456[c]2([cH]9[cH]8[cH]7[cH]12)[N]([Pd](Cl)([N]3=C1N(C(=C(N1C(C)C)C)C)C(C)C)Cl)=C1N(C(=C(N1C(C)C)C)C)C(C)C |
Title of publication | Ni-Fe and Pd-Fe Interactions in Nickel(II) and Palladium(II) Complexes of a Ferrocene-Bridged Bis(imidazolin-2-imine) Ligand. |
Authors of publication | Jess, Kristof; Baabe, Dirk; Bannenberg, Thomas; Brandhorst, Kai; Freytag, Matthias; Jones, Peter G.; Tamm, Matthias |
Journal of publication | Inorganic chemistry |
Year of publication | 2015 |
Journal volume | 54 |
Journal issue | 24 |
Pages of publication | 12032 - 12045 |
a | 9.5888 ± 0.0004 Å |
b | 14.2461 ± 0.0007 Å |
c | 12.1046 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1653.52 ± 0.13 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 18 |
Hermann-Mauguin space group symbol | P 21 21 2 |
Hall space group symbol | P 2 2ab |
Residual factor for all reflections | 0.0319 |
Residual factor for significantly intense reflections | 0.0312 |
Weighted residual factors for significantly intense reflections | 0.0822 |
Weighted residual factors for all reflections included in the refinement | 0.0828 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4346968.html
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Users of the data should acknowledge the original authors of the
structural data.